4-[6-azanyl-8-(3-fluorophenyl)-9-(4-methylphenyl)purin-2-yl]-2-methyl-butan-2-ol

Systemtic Name: 4-[6-azanyl-8-(3-fluorophenyl)-9-(4-methylphenyl)purin-2-yl]-2-methyl-butan-2-ol Openeye Name: 4-[6-amino-8-(3-fluorophenyl)-9-(p-tolyl)purin-2-yl]-2-methyl-butan-2-ol CAS Name: 4-[6-amino-8-(3-fluorophenyl)-9-(4-methylphenyl)-2-purinyl]-2-methyl-2-butanol IUPAC Name: 4-[6-amino-8-(3-fluorophenyl)-9-(4-methylphenyl)purin-2-yl]-2-methylbutan-2-ol Traditional Name: 4-[6-amino-8-(3-fluorophenyl)-9-(p-tolyl)purin-2-yl]-2-methyl-butan-2-ol Formula: C23H24FN5O MolecularWeight: 405.467963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=NC(=N3)CCC(C)(C)O)N)N=C2C4=CC(=CC=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=NC(=N3)CCC(C)(C)O)N)N=C2C4=CC(=CC=C4)F

InChI

InChI=1S/C23H24FN5O/c1-14-7-9-17(10-8-14)29-21(15-5-4-6-16(24)13-15)28-19-20(25)26-18(27-22(19)29)11-12-23(2,3)30/h4-10,13,30H,11-12H2,1-3H3,(H2,25,26,27)